Completing data — usually done within a minute
Basic information
- CAS
7461-94-1- Standard SMILES
CCCNC(=O)c1ccccc1O- InChIKey
IJIQGUFVADZGKO-UHFFFAOYSA-N- Molecular formula
- C10H13NO2
- Average molar mass
- 179.22 g/mol
- Monoisotopic mass
- 179.09462866
Names & identifiers
- Preferred name
- N-Propylsalicylamide
- IUPAC
- 2-hydroxy-N-propylbenzamide
Names & synonyms
2-hydroxy-N-propylbenzamideN-PropylsalicylamideBenzamide, 2-hydroxy-N-propyl-7461-94-18W7XWW74HSEINECS 231-250-0NSC-404130AI3-16240DTXSID80225597NSC 404130RefChem:831069DTXCID10148088
Show more names
231-250-0Salicylamide, N-propyl-NSC404130UNII-8W7XWW74HSSCHEMBL166777SCHEMBL1238119AKOS000207118DB-423449
Database identifiers
- CAS
7461-94-1- PubChem CID
- 81966
- DTXSID
DTXSID80225597- UNII
- 8W7XWW74HS
- EC Number
- 231-250-0
- Nikkaji
- J278.865I
Properties
Computed structural propertiesFilling in
- XLogP
- 2.2
- Topological polar surface area
- 49.3 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 3
- Heavy atoms
- 13
- Formal charge
- 0
- Complexity
- 170
Safety & regulation
GHS classification
GHS Classification
Danger
H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]
P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P354+P338, P317, P319, P321, P332+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 38 reports by companies from 1 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
Hazard information
Hazard Classes and CategoriesSkin Irrit. 2 (100%)
Related reactions
3 records
Compound notes
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